Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 4/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL25699735 | 0.78 | SLC6A2 (0.57) | SLC6A4SLC6A2SLC6A3MAOATAAR1 | |
| SCHEMBL25583216 | 0.78 | TRPA1 (0.52) | SLC6A4SLC6A2SLC6A3MAOALOXL2 | |
| SCHEMBL12327240 | 0.77 | SIGMAR1 (0.54) | SLC6A4SLC6A2SLC6A3MAOATAAR1 | |
| SCHEMBL13242159 | 0.77 | SIGMAR1 (0.54) | SLC6A4SLC6A2SLC6A3MAOATAAR1 | |
| SCHEMBL2406779 | 0.77 | TSHR (0.50) | GFERALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL22591638 | 0.77 | GFER (0.50) | SLC6A2SLC6A3MAOAGFERALDH1A1 | |
| SCHEMBL1718675 | 0.75 | TAAR1 (0.64) | SLC6A4SLC6A2SLC6A3MAOATAAR1 | |
| SCHEMBL1718685 | 0.75 | TAAR1 (0.64) | SLC6A4SLC6A2SLC6A3MAOATAAR1 | |
| SCHEMBL158968 | 0.75 | TAAR1 (0.64) | SLC6A4SLC6A2SLC6A3MAOATAAR1 | |
| SCHEMBL23511482 | 0.74 | CYP3A4 (0.43) | SLC6A4SLC6A2SLC6A3MAOAALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3192794-A1 | SUSTAINED HIV PROTEASE INHIBITOR | Shionogi & Co., Ltd. (JP) | 2017-07-19 | — | — | EP | disclosed |